1,3-bis[[(3-methylpyridin-2-yl)amino]methyl]benzimidazole-2-thione

Systemtic Name: 1,3-bis[[(3-methylpyridin-2-yl)amino]methyl]benzimidazole-2-thione Openeye Name: 1,3-bis[[(3-methyl-2-pyridyl)amino]methyl]benzimidazole-2-thione CAS Name: 1,3-bis[[(3-methyl-2-pyridinyl)amino]methyl]-2-benzimidazolethione IUPAC Name: 1,3-bis[[(3-methylpyridin-2-yl)amino]methyl]benzimidazole-2-thione Traditional Name: 1,3-bis[[(3-methyl-2-pyridyl)amino]methyl]benzimidazole-2-thione Formula: C21H22N6S MolecularWeight: 390.50458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NCN2C3=CC=CC=C3N(C2=S)CNC4=C(C=CC=N4)C

Isomeric SMILES

CC1=C(N=CC=C1)NCN2C3=CC=CC=C3N(C2=S)CNC4=C(C=CC=N4)C

InChI

InChI=1S/C21H22N6S/c1-15-7-5-11-22-19(15)24-13-26-17-9-3-4-10-18(17)27(21(26)28)14-25-20-16(2)8-6-12-23-20/h3-12H,13-14H2,1-2H3,(H,22,24)(H,23,25)